SCHEMBL6768665

SCHEMBL6768665

Cc1cccc(N=C(N)N2CCCc3ccccc32)c1C

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
TDP1 Q9NUW8 1/20 0.50
LMNA P02545 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
GAA P10253 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
NOTUM Q6P988 1/20 0.48
SIGMAR1 Q99720 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
SCN2A Q99250 1/20 0.46
ALDH1A1 P00352 2/20 0.46
HTT P42858 1/20 0.44
MGLL Q99685 1/20 0.44
NPY1R P25929 1/20 0.44
NPY2R P49146 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6774849 0.92 MAPT (0.58) MAPTTDP1LMNAKMT2AGAA
SCHEMBL6769257 0.85 SIGMAR1 (0.50) MAPTTDP1MEN1KMT2ANPSR1
SCHEMBL6769990 0.83 MAPT (0.62) MAPTTDP1MEN1KMT2ANOTUM
SCHEMBL6765676 0.81 MAPT (0.52) MAPTTDP1LMNAMEN1KMT2A
SCHEMBL6775636 0.81 MAPT (0.48) MAPTTDP1KMT2ANPSR1NOTUM
SCHEMBL6768618 0.81 SIGMAR1 (0.58) MAPTTDP1LMNANOTUMSIGMAR1
SCHEMBL7104957 0.81 SIGMAR1 (0.50) MAPTTDP1KMT2ANOTUMSIGMAR1
SCHEMBL7098241 0.81 ATM (0.51) MAPTTDP1LMNAMEN1KMT2A
SCHEMBL6768751 0.80 ATM (0.57) MAPTTDP1LMNAMEN1KMT2A
SCHEMBL6765723 0.80 SIGMAR1 (0.53) MAPTTDP1MEN1KMT2ANOTUM

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030153763-A1 Pharmaceutically active compounds and methods of use WYETH 2003-08-14 US claimed
US-20020099084-A1 Pharmaceutically active compounds and methods of use WYETH 2002-07-25 US claimed
US-6770668-B2 INDOLINYL, 1,2,3,4-TETRAHYDROQUINOLINYL, 1,2,3,4-TETRAHYDRO ISOQUINOLINYL, BENZ(CD)INDOLINYL AND 5,6-DIHYDROPHEN ANTHRIDINYL COMPOUNDS; TREATING NEURODEGENERATIVE DISORDERS WYETH 2004-08-03 US disclosed
US-20030153763-A1 Pharmaceutically active compounds and methods of use WYETH 2003-08-14 US disclosed
US-6514990-B2 Fused N-heterocylic rings substituted at the ring nitrogen with group of formula (R-N(-R1)-C(=NH)-); treating a neurodegenerative disease; N-(m-ethylphenyl)-1-indolinylcarboximidamide, for example SCION PHARMACEUTICALS, INC. 2003-02-04 US disclosed
US-20020099084-A1 Pharmaceutically active compounds and methods of use WYETH 2002-07-25 US disclosed
US-6358993-B1 TREATMENT OF NEUROLOGICAL INJURY AND NEURODEGENERATIVE DISORDERS; NEUROPROTECTIVE AGENTS; SUBSTITUTED INDOLINYL AND INDOLINYL GUANIDINE DERIVATIVES CENES PHARMACEUTICALS, INC. 2002-03-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030153763-A1 Pharmaceutically active compounds and methods of use ACHE, PARK7, NLN MAPT 122/4885TDP1 297/4885LMNA 1266/4885
US-20020099084-A1 Pharmaceutically active compounds and methods of use ACHE, PARK7, NLN MAPT 122/4885TDP1 297/4885LMNA 1266/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.